![1-(4,6-Bis[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]-1,3,5-triazin-2-yl)azepane](/api/spectrum/LjfveJafeoO/structure.png?h=300&w=458 "1-(4,6-Bis[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]-1,3,5-triazin-2-yl)azepane")
| SpectraBase Compound ID | LotTVDcKEmf |
|---|---|
| InChI | InChI=1S/C17H12F18N4/c18-12(19,20)10(13(21,22)23,14(24,25)26)7-36-8(38-9(37-7)39-5-3-1-2-4-6-39)11(15(27,28)29,16(30,31)32)17(33,34)35/h1-6H2 |
| InChIKey | PVSWIGMWTJVBGS-UHFFFAOYSA-N |
| Mol Weight | 614.28 g/mol |
| Molecular Formula | C17H12F18N4 |
| Exact Mass | 614.077453 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LjfveJafeoO |
|---|---|
| Name | 1-(4,6-Bis[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]-1,3,5-triazin-2-yl)azepane |
| Alternate Name(s) | 1,3,5-Triazine, 2-(perhydroazepin-1-yl)-4,6-bis(perfluoro-tert-butyl)- 1-[4,6-bis[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-1,3,5-triazin-2-yl]azepane 1-[4,6-bis[1,1,1,3,3,3-hexakis(fluoranyl)-2-(trifluoromethyl)propan-2-yl]-1,3,5-triazin-2-yl]azepane 1-[4,6-bis[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]-s-triazin-2-yl]azepane 2-(Hexahydroazepin-1-yl)-4,6-bis[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]-1,3,5-triazine |
| CAS Registry Number | 254118-25-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H12F18N4 |
| InChI | InChI=1S/C17H12F18N4/c18-12(19,20)10(13(21,22)23,14(24,25)26)7-36-8(38-9(37-7)39-5-3-1-2-4-6-39)11(15(27,28)29,16(30,31)32)17(33,34)35/h1-6H2 |
| InChIKey | PVSWIGMWTJVBGS-UHFFFAOYSA-N |
| Molecular Weight | 614.282 g/mol |
| SMILES | C(c1nc(N2CCCCCC2)nc(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)n1)(C(F)(F)F)(C(F)(F)F)C(F)(F)F |
| SPLASH | splash10-067i-9100010000-5752a14612d90d79f0b2 |
| Source of Spectrum | QF-48-1550-5 |
| Wiley ID | 833960 |